TL;DR: Propan-2-yl 6-[(4-fluorophenyl)carbamoyl]pyridine-2-carboxylate (CAS 313516-11-9) is a chemical compound with molecular formula C16H15FN2O3 and molecular weight 302.10666 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
propan-2-yl 6-[(4-fluorophenyl)carbamoyl]pyridine-2-carboxylate
Also Known As: propan-2-yl 6-[(4-fluorophenyl)carbamoyl]pyridine-2-carboxylate, 4P-084, isopropyl 6-[(4-fluorophenyl)carbamoyl]pyridine-2-carboxylate, propan-2-yl6-[(4-fluorophenyl)carbamoyl]pyridine-2-carboxylate
| Molecular Formula | C16H15FN2O3 |
| Molecular Weight | 302.10666 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 68.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 302.10666 Da |
| Heavy Atoms | 22 |
| Complexity | 395.0 |
| SMILES | CC(C)OC(=O)C1=CC=CC(=N1)C(=O)NC2=CC=C(C=C2)F |
| InChIKey | GGECTQWXEKBKPG-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that Propan-2-yl 6-[(4-fluorophenyl)carbamoyl]pyridine-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Propan-2-yl 6-[(4-fluorophenyl)carbamoyl]pyridine-2-carboxylate. Following Lipinski's Rule of Five, Propan-2-yl 6-[(4-fluorophenyl)carbamoyl]pyridine-2-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Propan-2-yl 6-[(4-fluorophenyl)carbamoyl]pyridine-2-carboxylate is 313516-11-9.
The molecular formula of Propan-2-yl 6-[(4-fluorophenyl)carbamoyl]pyridine-2-carboxylate is C16H15FN2O3.
The molecular weight of Propan-2-yl 6-[(4-fluorophenyl)carbamoyl]pyridine-2-carboxylate is 302.10666 g/mol.
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